COMPND    UNNAMED
AUTHOR    GENERATED BY OPEN BABEL 3.1.1
HETATM    1  O   UNL     1      -3.796  -0.582   0.002  1.00  0.00           O  
HETATM    2  C   UNL     1      -2.878   0.213  -0.004  1.00  0.00           C  
HETATM    3  OXT UNL     1      -3.134   1.536  -0.009  1.00  0.00           O  
HETATM    4  CA  UNL     1      -1.479  -0.270  -0.002  1.00  0.00           C  
HETATM    5  N   UNL     1      -0.493   0.608  -0.010  1.00  0.00           N  
HETATM    6  C   UNL     1       0.780   0.219  -0.009  1.00  0.00           C  
HETATM    7  C   UNL     1       1.099  -1.164   0.002  1.00  0.00           C  
HETATM    8  C   UNL     1       2.444  -1.565   0.004  1.00  0.00           C  
HETATM    9  C   UNL     1       3.430  -0.624  -0.003  1.00  0.00           C  
HETATM   10  C   UNL     1       3.126   0.734  -0.013  1.00  0.00           C  
HETATM   11  C   UNL     1       1.830   1.164  -0.016  1.00  0.00           C  
HETATM   12  O   UNL     1       1.551   2.493  -0.026  1.00  0.00           O  
HETATM   13  C   UNL     1       0.055  -2.109   0.009  1.00  0.00           C  
HETATM   14  C   UNL     1      -1.230  -1.652   0.013  1.00  0.00           C  
HETATM   15  HXT UNL     1      -4.063   1.803  -0.006  1.00  0.00           H  
HETATM   16  H   UNL     1       2.697  -2.615   0.012  1.00  0.00           H  
HETATM   17  H   UNL     1       4.464  -0.938  -0.001  1.00  0.00           H  
HETATM   18  H   UNL     1       3.927   1.458  -0.019  1.00  0.00           H  
HETATM   19  H   UNL     1       1.471   2.885   0.854  1.00  0.00           H  
HETATM   20  H   UNL     1       0.267  -3.169   0.021  1.00  0.00           H  
HETATM   21  H   UNL     1      -2.054  -2.350   0.020  1.00  0.00           H  
CONECT    1    2    2                                                 
CONECT    2    1    1    4    3                                       
CONECT    3    2   15                                                 
CONECT    4   14    2    5    5                                       
CONECT    5    4    4    6                                            
CONECT    6    7    5   11   11                                       
CONECT    7   13    8    8    6                                       
CONECT    8    7    7    9   16                                       
CONECT    9    8   10   10   17                                       
CONECT   10    9    9   11   18                                       
CONECT   11    6    6   10   12                                       
CONECT   12   11   19                                                 
CONECT   13   14   14    7   20                                       
CONECT   14   13   13    4   21                                       
CONECT   15    3                                                      
CONECT   16    8                                                      
CONECT   17    9                                                      
CONECT   18   10                                                      
CONECT   19   12                                                      
CONECT   20   13                                                      
CONECT   21   14                                                      
MASTER        0    0    0    0    0    0    0    0   21    0   21    0
END
